| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 18 | Yes |
Popular Name: (1S,2S)-1-(4-bromophenyl)-N1-cyclopentyl-N1-methyl-propane-1,2-diamine (1S,2S)-1-(4-bromophenyl)-N1-cyc…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.34 | 7.96 | -124.3 | 4 | 2 | 2 | 32 | 313.283 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.34 | 7.26 | -32.69 | 3 | 2 | 1 | 30 | 312.275 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.34 | 6.36 | -41.43 | 3 | 2 | 1 | 31 | 312.275 | 4 | ↓ |
